Geometry & MOs

Info

ID:	39785
PubChem CID:	8142274
Reduced:	NO2C21H25 (1)
Stoich.:	AB2C21D25 (1)
Weight, g/mol:	403.178358
ΔH_f, kcal/mol:	-57.9
Dipole, Da:	2.11
IP(EA), eV:	-8.8(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2,5-dimethoxyphenyl)-N-[(R)-(4-methoxyphenyl)-phenylmethyl]prop-2-enamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@@H](C2=CC=CC=C2)NC(=O)C3CCCCC3

DOS

IR

Vibrations