Geometry & MOs

Info

ID:	136832
PubChem CID:	52109266
Reduced:	Cl2N4H18C19 (1)
Stoich.:	A2B4C18D19 (1)
Weight, g/mol:	372.090852
ΔH_f, kcal/mol:	61.05
Dipole, Da:	4.95
IP(EA), eV:	-8.56(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dichlorophenyl)-4-piperidin-1-ylquinazolin-2-amine

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC(=NC3=CC=CC=C32)NC4=C(C(=CC=C4)Cl)Cl

DOS

IR

Vibrations