Geometry & MOs

Info

ID:	135510
PubChem CID:	51883232
Reduced:	SN2O4C19H28 (1)
Stoich.:	AB2C4D19E28 (1)
Weight, g/mol:	380.176979
ΔH_f, kcal/mol:	-150.47
Dipole, Da:	7.63
IP(EA), eV:	-9.54(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methoxyphenyl)sulfonyl-prop-2-enylamino]-N-[(1R,2R)-2-methylcyclohexyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCC[C@@H]1NC(=O)CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations