Geometry & MOs

Info

ID:	280536
PubChem CID:	103849788
Reduced:	NO4C12H15 (1)
Stoich.:	AB4C12D15 (1)
Weight, g/mol:	273.168856
ΔH_f, kcal/mol:	-158.32
Dipole, Da:	3.94
IP(EA), eV:	-9.57(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(carbamoylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]-4-methylpentanamide

Drug info:

PubChemData

Smile

C1COCC1(CNC(=O)C2=CC=CC=C2O)O

DOS

IR

Vibrations