Geometry & MOs

Info

ID:	273525
PubChem CID:	103771300
Reduced:	NO3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	231.158292
ΔH_f, kcal/mol:	-145.62
Dipole, Da:	3.24
IP(EA), eV:	-9.27(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(carbamoylamino)-N-(2-hydroxy-4-methylpentyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1OCCC(=O)NCC(CC(C)C)O

DOS

IR

Vibrations