Geometry & MOs

Info

ID:	27419
PubChem CID:	821256
Reduced:	N2O3C12H12 (1)
Stoich.:	A2B3C12D12 (1)
Weight, g/mol:	215.105862
ΔH_f, kcal/mol:	-94.42
Dipole, Da:	6.92
IP(EA), eV:	-9.27(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pyrrolidin-1-yl-1H-quinazolin-4-one

Drug info:

PubChemData

Smile

CCOC(=O)CC1=NC(=O)C2=CC=CC=C2N1

DOS

IR

Vibrations