Geometry & MOs

Info

ID:

130108

PubChem CID:

51074947

Reduced:

NOC10H10 (2)

Stoich.:

ABC10D10 (2)

Weight, g/mol:

230.141913

ΔHf, kcal/mol:

-23.99

Dipole, Da:

5.5

IP(EA), eV:

-8.91(-0.77)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-cyclopropyl-N-(pyridin-4-ylmethyl)cyclobutanecarboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1OC)NC(=O)CC2=CC=CC3=C2N=CC=C3

DOS

IR

Vibrations