Geometry & MOs

Info

ID:	273394
PubChem CID:	103771025
Reduced:	INO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	299.140055
ΔH_f, kcal/mol:	-82.98
Dipole, Da:	2.68
IP(EA), eV:	-9.49(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloropyridin-2-yl)-methylamino]-N-(2-hydroxy-4-methylpentyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NCC(CC(C)C)O)I

DOS

IR

Vibrations