Geometry & MOs

Info

ID:	178980
PubChem CID:	76412834
Reduced:	N3O4C28H45 (1)
Stoich.:	A3B4C28D45 (1)
Weight, g/mol:	501.094762
ΔH_f, kcal/mol:	-200.29
Dipole, Da:	6.96
IP(EA), eV:	-9.22(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[5-[3-[(4-chlorophenyl)carbamoylamino]phenyl]thiophen-2-yl]thian-2-yl]-N-hydroxyacetamide

Drug info:

PubChemData

Smile

CC(C)CN(C(=O)C(CC(=O)NC(C(=O)NC(C)(C)C1=CC=CC=C1)C(C)(C)C)C2CCCC2)O

DOS

IR

Vibrations