Geometry & MOs

Info

ID:	66373
PubChem CID:	46504464
Reduced:	SN2O4C36H50 (1)
Stoich.:	AB2C4D36E50 (1)
Weight, g/mol:	519.219178
ΔH_f, kcal/mol:	-175.06
Dipole, Da:	1.6
IP(EA), eV:	-8.5(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethoxypropyl)-2-[[2-(1H-indol-3-yl)acetyl]-(thiophen-2-ylmethyl)amino]-2-(4-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCOCCCNC(=O)C(C1=CC=C(C=C1)C)N(CC2=CC=CS2)C(=O)CCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

DOS

IR

Vibrations