Geometry & MOs

Info

ID:	265051
PubChem CID:	103508317
Reduced:	ON2S2C16H26 (1)
Stoich.:	AB2C2D16E26 (1)
Weight, g/mol:	333.118084
ΔH_f, kcal/mol:	-46.52
Dipole, Da:	6.45
IP(EA), eV:	-8.17(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-(4-methylhexan-2-ylamino)-4-methylsulfonylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C)CC(C)NC1=C(C(=C(S1)C(=O)C2CC2)N)SC

DOS

IR

Vibrations