Geometry & MOs

Info

ID:	197545
PubChem CID:	78976366
Reduced:	N2O3C13H24 (1)
Stoich.:	A2B3C13D24 (1)
Weight, g/mol:	298.135114
ΔH_f, kcal/mol:	-174.66
Dipole, Da:	6.47
IP(EA), eV:	-9.71(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-methyl-2-(1-thiophen-3-ylpropan-2-ylcarbamoylamino)pentanoic acid

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)N[C@H](CC(C)C)C(=O)O

DOS

IR

Vibrations