Geometry & MOs

Info

ID:	45379
PubChem CID:	10512367
Reduced:	ClNO3C8H10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	203.025025
ΔH_f, kcal/mol:	-94.44
Dipole, Da:	5.12
IP(EA), eV:	-10.65(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloropyrazolo[1,5-c]quinazoline

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(ON=C1CCl)C

DOS

IR

Vibrations