Geometry & MOs

Info

ID:	171877
PubChem CID:	75436394
Reduced:	ON2C9H9 (2)
Stoich.:	AB2C9D9 (2)
Weight, g/mol:	287.17461
ΔH_f, kcal/mol:	2.88
Dipole, Da:	5.07
IP(EA), eV:	-8.34(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[1-(4-methylmorpholin-2-yl)ethyl]quinazoline-2,4-diamine

Drug info:

PubChemData

Smile

C1COC2=CC=CC(=C2OC1)CNC3=NC4=CC=CC=C4C(=N3)N

DOS

IR

Vibrations