Geometry & MOs

Info

ID:	62042
PubChem CID:	26717186
Reduced:	ClON2H15C18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	391.178358
ΔH_f, kcal/mol:	18.67
Dipole, Da:	5.37
IP(EA), eV:	-9.09(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[(1R)-1-naphthalen-2-ylethyl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC2=CC=CC=C2C=C1)NC(=O)C3=CN=C(C=C3)Cl

DOS

IR

Vibrations