Geometry & MOs

Info

ID:	343355
PubChem CID:	127266528
Reduced:	NO4C17H25 (1)
Stoich.:	AB4C17D25 (1)
Weight, g/mol:	349.09819
ΔH_f, kcal/mol:	-170.45
Dipole, Da:	3.12
IP(EA), eV:	-8.76(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[3-(2-pyrazin-2-ylprop-1-enyl)phenyl]benzamide

Drug info:

PubChemData

Smile

CC(C)COC1=CC=CC(=C1)CN2C[C@@H](C[C@H]2C(=O)OC)O

DOS

IR

Vibrations