Geometry & MOs

Info

ID:	262076
PubChem CID:	103268333
Reduced:	NSO3C11H21 (1)
Stoich.:	ABC3D11E21 (1)
Weight, g/mol:	189.147727
ΔH_f, kcal/mol:	-148.89
Dipole, Da:	5.8
IP(EA), eV:	-8.7(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-(2-hydroxypentylamino)propanamide

Drug info:

PubChemData

Smile

CCC(CSC)NCC1CCC(O1)C(=O)O

DOS

IR

Vibrations