Geometry & MOs

Info

ID:	231010
PubChem CID:	87572447
Reduced:	N2O3C12H24 (1)
Stoich.:	A2B3C12D24 (1)
Weight, g/mol:	244.178693
ΔH_f, kcal/mol:	-179.67
Dipole, Da:	2.07
IP(EA), eV:	-9.75(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-4-methyl-1-(2-methylbutylamino)-1-oxopentan-2-yl]carbamic acid

Drug info:

PubChemData

Smile

CCC(C)CNC(=O)C(CC(C)C)NC(=O)O

DOS

IR

Vibrations