Geometry & MOs

Info

ID:	22881
PubChem CID:	599363
Reduced:	N5C17H17 (1)
Stoich.:	A5B17C17 (1)
Weight, g/mol:	291.148396
ΔH_f, kcal/mol:	78.38
Dipole, Da:	1.2
IP(EA), eV:	-8.32(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-dihydroindol-1-ylmethyl)quinazoline-2,4-diamine

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C21)CC3=CC4=C(C=C3)N=C(N=C4N)N

DOS

IR

Vibrations