Geometry & MOs

Info

ID:	147510
PubChem CID:	53787166
Reduced:	ON4H22C24 (1)
Stoich.:	AB4C22D24 (1)
Weight, g/mol:	441.205242
ΔH_f, kcal/mol:	106.22
Dipole, Da:	2.16
IP(EA), eV:	-8.21(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl] N-benzylcarbamate

Drug info:

PubChemData

Smile

CC1=C2C(=C(C=C1)/C=N\NC3=CC=CC=C3)C=C(O2)/C(=N\NC4=CC=CC=C4)/C

DOS

IR

Vibrations