Geometry & MOs

Info

ID:	281010
PubChem CID:	103852387
Reduced:	ClN2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	273.205242
ΔH_f, kcal/mol:	-145.25
Dipole, Da:	4.33
IP(EA), eV:	-9.98(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(carbamoylamino)-N-(1-hydroxy-4-methylpentan-3-yl)-3-methylpentanamide

Drug info:

PubChemData

Smile

CC(C)C(CCO)NC(=O)CNC(=O)C1=CC=C(C=C1)Cl

DOS

IR

Vibrations