Geometry & MOs

Info

ID:	275155
PubChem CID:	103814166
Reduced:	OSN3C10H15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	231.194677
ΔH_f, kcal/mol:	-13.62
Dipole, Da:	1.66
IP(EA), eV:	-9.15(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]pentanamide

Drug info:

PubChemData

Smile

C1CCN[C@H](C1)C(=O)NCC2=CSC=N2

DOS

IR

Vibrations