Geometry & MOs

Info

ID:	146914
PubChem CID:	53771246
Reduced:	ClOH7C9 (1)
Stoich.:	ABC7D9 (1)
Weight, g/mol:	147.079647
ΔH_f, kcal/mol:	-6.77
Dipole, Da:	1.25
IP(EA), eV:	-9.46(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydropyrido[1,2-a]pyrimidin-4-imine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)CC=C=O

DOS

IR

Vibrations