Geometry & MOs

Info

ID:	13906
PubChem CID:	399834
Reduced:	O2N5C14H19 (1)
Stoich.:	A2B5C14D19 (1)
Weight, g/mol:	289.153875
ΔH_f, kcal/mol:	40.72
Dipole, Da:	8.78
IP(EA), eV:	-8.62(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,2-N-diethyl-4-N,4-N-dimethyl-7-nitroquinazoline-2,4-diamine

Drug info:

PubChemData

Smile

CCN(CC)C1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=N1)N(C)C

DOS

IR

Vibrations