Geometry & MOs

Info

ID:	281519
PubChem CID:	103913984
Reduced:	SN3O3C14H25 (1)
Stoich.:	AB3C3D14E25 (1)
Weight, g/mol:	286.225643
ΔH_f, kcal/mol:	-128.92
Dipole, Da:	4.97
IP(EA), eV:	-9.48(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-hydroxy-3-(3-methylcyclohexyl)oxypropyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CCOCC(CNC(C(C)C)C(=O)N)O

DOS

IR

Vibrations