Geometry & MOs

Info

ID:	66371
PubChem CID:	46504462
Reduced:	N2O5C31H46 (1)
Stoich.:	A2B5C31D46 (1)
Weight, g/mol:	507.219178
ΔH_f, kcal/mol:	-235.61
Dipole, Da:	4.25
IP(EA), eV:	-8.59(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-(3-ethoxypropylamino)-1-(4-methylphenyl)-2-oxoethyl]-(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CCOCCCNC(=O)C(C1=CC=C(C=C1)OC)NC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

DOS

IR

Vibrations