Geometry & MOs

Info

ID:	51467
PubChem CID:	12014137
Reduced:	O2N4H32C37 (1)
Stoich.:	A2B4C32D37 (1)
Weight, g/mol:	411.194677
ΔH_f, kcal/mol:	58.44
Dipole, Da:	3.67
IP(EA), eV:	-8.44(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[N-(2-anilinoethyl)anilino]-1-hydroxy-4,5-dihydro-3H-benzo[e]indol-2-one

Drug info:

PubChemData

Smile

C1CC(=CC2=CC=CC=C21)N3C(=O)C4(N(CCN4C5=CC=CC=C5)C6=CC=CC=C6)N(C3=O)C7=CC8=CC=CC=C8CC7

DOS

IR

Vibrations