Geometry & MOs

Info

ID:	447462
PubChem CID:	135283049
Reduced:	ClN2O3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	344.07356
ΔH_f, kcal/mol:	-108.52
Dipole, Da:	5.68
IP(EA), eV:	-9.61(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-3-methylpyridin-2-yl)oxy-(2,4-dimethylpentan-2-yl)carbamic acid

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1ON(C(=O)O)C(C)(C)CC(C)C)Cl

DOS

IR

Vibrations