Geometry & MOs

Info

ID:	147865
PubChem CID:	53787523
Reduced:	NO4C52H91 (1)
Stoich.:	AB4C52D91 (1)
Weight, g/mol:	340.168797
ΔH_f, kcal/mol:	-281.05
Dipole, Da:	4.28
IP(EA), eV:	-8.53(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-4-N-(2-methylphenyl)-2-N-phenylquinazoline-2,4-diamine

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC(CCCCCCCC)COC1C(C(CC(O1)C)N(C)C)OC(=O)C=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C

DOS

IR

Vibrations