Geometry & MOs

Info

ID:	274871
PubChem CID:	103812129
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	202.168128
ΔH_f, kcal/mol:	-104.71
Dipole, Da:	1.44
IP(EA), eV:	-9.25(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(2-hydroxy-4-methylpentyl)butanamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)CNCC1CC1)O

DOS

IR

Vibrations