Geometry & MOs

Info

ID:	285478
PubChem CID:	104109159
Reduced:	NO4C15H23 (1)
Stoich.:	AB4C15D23 (1)
Weight, g/mol:	201.172879
ΔH_f, kcal/mol:	-172.77
Dipole, Da:	3.39
IP(EA), eV:	-8.55(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxypentan-2-yl)-2-methylpentanamide

Drug info:

PubChemData

Smile

CC(CC(C)O)NC(=O)CC1=CC(=C(C=C1)OC)OC

DOS

IR

Vibrations