Geometry & MOs

Info

ID:	16421
PubChem CID:	467890
Reduced:	N5C12H13 (1)
Stoich.:	A5B12C13 (1)
Weight, g/mol:	227.117095
ΔH_f, kcal/mol:	57.81
Dipole, Da:	5.46
IP(EA), eV:	-7.93(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,8-dimethylpyrrolo[3,2-f]quinazoline-1,3-diamine

Drug info:

PubChemData

Smile

CC1=CC2=C(N1C)C=CC3=C2C(=NC(=N3)N)N

DOS

IR

Vibrations