Geometry & MOs

Info

ID:	206606
PubChem CID:	80272591
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	-84.18
Dipole, Da:	4.64
IP(EA), eV:	-8.16(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanopropyl)-2-(ethylamino)-N,4-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)N(C)C(C)COC)NC

DOS

IR

Vibrations