Geometry & MOs

Info

ID:	19259
PubChem CID:	559325
Reduced:	O2N4C19H30 (1)
Stoich.:	A2B4C19D30 (1)
Weight, g/mol:	346.236876
ΔH_f, kcal/mol:	-41.06
Dipole, Da:	5.86
IP(EA), eV:	-7.96(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(5,8-dimethoxyquinazolin-6-yl)-1-N,1-N-diethylpentane-1,4-diamine

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC1=CC(=C2C(=C1OC)C=NC=N2)OC

DOS

IR

Vibrations