Geometry & MOs

Info

ID:	52443
PubChem CID:	12015306
Reduced:	NC7H12 (2)
Stoich.:	AB7C12 (2)
Weight, g/mol:	688.373704
ΔH_f, kcal/mol:	-10.47
Dipole, Da:	1.45
IP(EA), eV:	-8.72(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,16-dibenzyl-7,13-dimorpholin-4-yl-6,14-dioxa-3,17,24,25-tetrazatetracyclo[17.3.1.15,8.112,15]pentacosa-1(23),5(25),7,12,15(24),19,21-heptaene

Drug info:

PubChemData

Smile

CCNCC1=CC(=C(C=C1C)C)CNCC

DOS

IR

Vibrations