Geometry & MOs

Info

ID:	175486
PubChem CID:	75910564
Reduced:	NO2C11H16 (2)
Stoich.:	AB2C11D16 (2)
Weight, g/mol:	418.246772
ΔH_f, kcal/mol:	-158.92
Dipole, Da:	9.95
IP(EA), eV:	-8.8(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-1-[3-(3,4,5-trimethoxyphenyl)prop-2-enoylamino]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1(CCCCC1)NC(=O)C=CC2=C(C=C(C=C2)OC)OC

DOS

IR

Vibrations