Geometry & MOs

Info

ID:	31822
PubChem CID:	3719666
Reduced:	SO3N6C28H34 (1)
Stoich.:	AB3C6D28E34 (1)
Weight, g/mol:	586.217129
ΔH_f, kcal/mol:	-64.93
Dipole, Da:	9.39
IP(EA), eV:	-8.43(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(thiophen-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)CC(C)NC(=S)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NC3=CC=C(C=C3)N4C=CN=C4

DOS

IR

Vibrations