Geometry & MOs

Info

ID:	273517
PubChem CID:	103771282
Reduced:	NSO2C12H19 (1)
Stoich.:	ABC2D12E19 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-97.95
Dipole, Da:	2.68
IP(EA), eV:	-9.32(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-4-propan-2-ylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)NCC(CC(C)C)O

DOS

IR

Vibrations