Geometry & MOs

Info

ID:	82175
PubChem CID:	49855723
Reduced:	ClFON4H18C20 (1)
Stoich.:	ABCD4E18F20 (1)
Weight, g/mol:	450.147902
ΔH_f, kcal/mol:	-26.19
Dipole, Da:	1.78
IP(EA), eV:	-8.91(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-1-[3-(3-fluoroanilino)-2-(4-fluorophenyl)-8,8-dimethyl-5,6-dihydroimidazo[1,2-a]pyrazin-7-yl]ethanone

Drug info:

PubChemData

Smile

CC1(C2=NC(=C(N2CC(=O)N1)NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)F)C

DOS

IR

Vibrations