Geometry & MOs

Info

ID:	240291
PubChem CID:	93576773
Reduced:	OSN2C12H18 (1)
Stoich.:	ABC2D12E18 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-49.69
Dipole, Da:	1.99
IP(EA), eV:	-8.28(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[(1R,3R)-3-methylcyclohexyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1CCC[C@@H](C1)NC(=O)C2=C(C=CS2)N

DOS

IR

Vibrations