Geometry & MOs

Info

ID:

298983

PubChem CID:

117665014

Reduced:

N3O4C29H31 (1)

Stoich.:

A3B4C29D31 (1)

Weight, g/mol:

607.264016

ΔHf, kcal/mol:

-78.22

Dipole, Da:

7.16

IP(EA), eV:

 -8.76(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-benzhydryl-N-cyclooctyl-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=C(C=CC(=C2)C3=CC4=C(C=C3)C=CN4)N(CCCCCCC(=O)NO)C(=O)O

DOS

IR

Vibrations