Geometry & MOs

Info

ID:	258679
PubChem CID:	103156202
Reduced:	SN3O4C10H15 (1)
Stoich.:	AB3C4D10E15 (1)
Weight, g/mol:	256.215078
ΔH_f, kcal/mol:	-144.42
Dipole, Da:	6.12
IP(EA), eV:	-9.59(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(4,4-dimethylcyclohexyl)-3-methoxy-N-methylbutanamide

Drug info:

PubChemData

Smile

CC1=NSC(=C1C(=O)O)NC(=O)CC(CN)OC

DOS

IR

Vibrations