Geometry & MOs

Info

ID:	342579
PubChem CID:	127265739
Reduced:	ClO2N3H10C13 (1)
Stoich.:	AB2C3D10E13 (1)
Weight, g/mol:	276.107419
ΔH_f, kcal/mol:	62.39
Dipole, Da:	5.18
IP(EA), eV:	-10.11(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[4-(2,2-difluoroethoxy)phenyl]prop-1-en-2-yl]pyrazine

Drug info:

PubChemData

Smile

CC(=CC1=C(C=C(C=C1)[N+](=O)[O-])Cl)C2=NC=CN=C2

DOS

IR

Vibrations