Geometry & MOs

Info

ID:	68542
PubChem CID:	46508613
Reduced:	O2N4C29H34 (1)
Stoich.:	A2B4C29D34 (1)
Weight, g/mol:	470.231791
ΔH_f, kcal/mol:	-24.76
Dipole, Da:	8.25
IP(EA), eV:	-7.57(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-[1-(3-benzamidophenyl)ethyl-methylamino]acetyl]amino]-N-cyclopropylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)CN(C)C(C)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations