Geometry & MOs

Info

ID:	252661
PubChem CID:	103113064
Reduced:	SN3O4C11H15 (1)
Stoich.:	AB3C4D11E15 (1)
Weight, g/mol:	284.173607
ΔH_f, kcal/mol:	-140.91
Dipole, Da:	8.12
IP(EA), eV:	-9.9(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]carbamoyl]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)C1=NC(=CS1)C(=O)O

DOS

IR

Vibrations