Geometry & MOs

Info

ID:	425785
PubChem CID:	135127999
Reduced:	N2C11H12 (2)
Stoich.:	A2B11C12 (2)
Weight, g/mol:	370.125218
ΔH_f, kcal/mol:	88.2
Dipole, Da:	4.33
IP(EA), eV:	-8.47(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1-benzothiophen-5-yl)-2-(3,4-dihydropyridin-3-yl)-N-methylquinazolin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2CC=C3C(=C2)C(N=C(N3)C4=CN=CC=C4)NC)C

DOS

IR

Vibrations