Geometry & MOs

Info

ID:	229173
PubChem CID:	87567114
Reduced:	N2O4C25H26 (1)
Stoich.:	A2B4C25D26 (1)
Weight, g/mol:	378.039433
ΔH_f, kcal/mol:	-26.62
Dipole, Da:	6.93
IP(EA), eV:	-9.09(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3,4-bis(difluoromethoxy)phenyl]-3-(5-chloropyrazin-2-yl)propan-1-one

Drug info:

PubChemData

Smile

C1CC1COC2=CC=CC(=C2)/C(=C/C3=CC=C(C=C3)/C=C/C(=O)NO)/C(=O)NC4CC4

DOS

IR

Vibrations