Geometry & MOs

Info

ID:	425790
PubChem CID:	135128035
Reduced:	NO2C16H19 (1)
Stoich.:	AB2C16D19 (1)
Weight, g/mol:	388.189926
ΔH_f, kcal/mol:	10.36
Dipole, Da:	3.97
IP(EA), eV:	-8.29(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,5-dimethoxyphenyl)-N-methyl-2-(2-methyl-2,3-dihydropyridin-5-yl)quinazolin-4-amine

Drug info:

PubChemData

Smile

CC(C)C1=C(C=CC(=C1)C2=CC(=CC=C2)OOC)N

DOS

IR

Vibrations