Geometry & MOs

Info

ID:	175088
PubChem CID:	75853967
Reduced:	ON2C10H10 (2)
Stoich.:	AB2C10D10 (2)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-16.29
Dipole, Da:	9.45
IP(EA), eV:	-8.56(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)N3C=NC4=CC=CC=C43

DOS

IR

Vibrations