Geometry & MOs

Info

ID:	273504
PubChem CID:	103771248
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	306.161329
ΔH_f, kcal/mol:	-41.57
Dipole, Da:	5.0
IP(EA), eV:	-9.4(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-1-methylsulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=NN(C=C1)C2=CC=CC=C2)O

DOS

IR

Vibrations