Geometry & MOs

Info

ID:	69941
PubChem CID:	47205837
Reduced:	SN3O5C11H17 (1)
Stoich.:	AB3C5D11E17 (1)
Weight, g/mol:	252.183778
ΔH_f, kcal/mol:	-182.83
Dipole, Da:	5.52
IP(EA), eV:	-9.92(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

C1CC1C(=O)NCC(=O)NNC(=O)C2CCS(=O)(=O)C2

DOS

IR

Vibrations