Geometry & MOs

Info

ID:	129713
PubChem CID:	51073623
Reduced:	ON2C17H18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	277.121512
ΔH_f, kcal/mol:	26.8
Dipole, Da:	4.11
IP(EA), eV:	-9.5(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-cyclopropyl-N-(pyridin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)N(CC2=CC=NC=C2)C3CC3

DOS

IR

Vibrations