Geometry & MOs

Info

ID:	278089
PubChem CID:	103833271
Reduced:	ON2C11H22 (1)
Stoich.:	AB2C11D22 (1)
Weight, g/mol:	230.145285
ΔH_f, kcal/mol:	-60.78
Dipole, Da:	2.76
IP(EA), eV:	-9.61(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-methyl-N-(thian-3-yl)pentanamide

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)NCC1(CC1)C)N

DOS

IR

Vibrations