Geometry & MOs

Info

ID:	212840
PubChem CID:	81061993
Reduced:	NO2C17H31 (1)
Stoich.:	AB2C17D31 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-129.04
Dipole, Da:	2.17
IP(EA), eV:	-8.81(2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyethyl)-4-(3-hydroxyprop-1-ynyl)-N-methylbenzamide

Drug info:

PubChemData

Smile

CCOCCN(C)CC(C12CC3CC(C1)CC(C3)C2)O

DOS

IR

Vibrations