Geometry & MOs

Info

ID:	152527
PubChem CID:	56311480
Reduced:	ON2C14H19 (2)
Stoich.:	AB2C14D19 (2)
Weight, g/mol:	353.246713
ΔH_f, kcal/mol:	-33.76
Dipole, Da:	6.05
IP(EA), eV:	-8.66(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocycloheptyl)-2-[cyclopropylmethyl(1-phenylethyl)amino]acetamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=O)CN(CC3CC3)C(C)C4=CC=CC=C4

DOS

IR

Vibrations