Geometry & MOs

Info

ID:	83046
PubChem CID:	49857055
Reduced:	OF3N5H18C20 (1)
Stoich.:	AB3C5D18E20 (1)
Weight, g/mol:	429.177645
ΔH_f, kcal/mol:	-91.63
Dipole, Da:	5.1
IP(EA), eV:	-9.12(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[3-(3,5-difluoroanilino)-2-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-methylpropan-1-one

Drug info:

PubChemData

Smile

C1CN2C(=NC(=C2NC3=CC(=C(C=C3)F)F)C4=CC=C(C=C4)F)CN1C(=O)CN

DOS

IR

Vibrations