Geometry & MOs

Info

ID:	9464
PubChem CID:	89763
Reduced:	N3O3C14H19 (1)
Stoich.:	A3B3C14D19 (1)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	-85.17
Dipole, Da:	7.73
IP(EA), eV:	-8.15(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[2-cyanoethyl(2-hydroxyethyl)amino]-4-methoxyphenyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=C(C=C1)OC)N(CCC#N)CCO

DOS

IR

Vibrations