Geometry & MOs

Info

ID:	176487
PubChem CID:	76059106
Reduced:	SN4O6C32H32 (1)
Stoich.:	AB4C6D32E32 (1)
Weight, g/mol:	280.145678
ΔH_f, kcal/mol:	-143.82
Dipole, Da:	7.74
IP(EA), eV:	-9.35(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-5-cyclohexyl-2,3-dihydroxypentane-1-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1C2N(C1=O)C(C(=CS2)C(=C3CCNC3=O)CC#N)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations