Geometry & MOs

Info

ID:	277904
PubChem CID:	103831760
Reduced:	ON4C11H20 (1)
Stoich.:	AB4C11D20 (1)
Weight, g/mol:	262.117356
ΔH_f, kcal/mol:	-29.11
Dipole, Da:	2.03
IP(EA), eV:	-8.36(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(1,4-dithian-2-ylmethyl)hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1=CN(N=C1C)C)N

DOS

IR

Vibrations