Geometry & MOs

Info

ID:	194430
PubChem CID:	78534772
Reduced:	N2O5C21H22 (1)
Stoich.:	A2B5C21D22 (1)
Weight, g/mol:	346.120509
ΔH_f, kcal/mol:	-172.01
Dipole, Da:	4.53
IP(EA), eV:	-8.79(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenacyl 3-(6-methoxynaphthalen-2-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)CCN2C(=O)COC3=CC=CC=C32

DOS

IR

Vibrations