Geometry & MOs

Info

ID:	272665
PubChem CID:	103750803
Reduced:	SN2O3C14H18 (1)
Stoich.:	AB2C3D14E18 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-80.8
Dipole, Da:	4.43
IP(EA), eV:	-9.39(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxy-4-methylpentan-3-yl)-3-(methoxymethyl)benzamide

Drug info:

PubChemData

Smile

CC(C)C(CCO)NC(=O)C1=CSC(=N1)C2=CC=CO2

DOS

IR

Vibrations