Geometry & MOs

Info

ID:	342575
PubChem CID:	127265735
Reduced:	ON3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	290.082205
ΔH_f, kcal/mol:	55.35
Dipole, Da:	2.59
IP(EA), eV:	-9.01(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(2-chloro-3,4-dimethoxyphenyl)prop-1-en-2-yl]pyrazine

Drug info:

PubChemData

Smile

CC(=CC1=CC(=CC=C1)OCCCC#N)C2=NC=CN=C2

DOS

IR

Vibrations