Geometry & MOs

Info

ID:	402994
PubChem CID:	135058223
Reduced:	NOSiC21H31 (1)
Stoich.:	ABCD21E31 (1)
Weight, g/mol:	336.158626
ΔH_f, kcal/mol:	-13.95
Dipole, Da:	4.02
IP(EA), eV:	-7.9(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-(2-methylpropyl)-6-nitroquinazolin-4-amine

Drug info:

PubChemData

Smile

CC(C)[Si](C#CC1=CC2=C(N1C)C=CC(=C2)OC)(C(C)C)C(C)C

DOS

IR

Vibrations