Geometry & MOs

Info

ID:	271662
PubChem CID:	103687732
Reduced:	NSO3C14H15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	312.241293
ΔH_f, kcal/mol:	-94.79
Dipole, Da:	2.85
IP(EA), eV:	-8.67(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(2-hydroxycyclohexyl)methylamino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(CC1=CC=CS1)NC(=O)C2=C(C=CC(=C2)O)O

DOS

IR

Vibrations