Geometry & MOs

Info

ID:	128813
PubChem CID:	51059207
Reduced:	SN2H16C17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	415.168462
ΔH_f, kcal/mol:	68.34
Dipole, Da:	4.11
IP(EA), eV:	-8.31(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anthracen-9-yl-7,8-dimethyl-3-phenylimidazo[1,2-a]pyrimidin-5-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2=CN(C(=N)S2)C3=CC=CC=C3)C

DOS

IR

Vibrations