Geometry & MOs

Info

ID:	279899
PubChem CID:	103845583
Reduced:	ClNO3C16H24 (1)
Stoich.:	ABC3D16E24 (1)
Weight, g/mol:	264.183778
ΔH_f, kcal/mol:	-128.96
Dipole, Da:	5.15
IP(EA), eV:	-8.78(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[2-ethyl-2-(hydroxymethyl)butyl]amino]methyl]benzamide

Drug info:

PubChemData

Smile

CCC(CC)(CNCC1=CC2=C(C(=C1)Cl)OCCO2)CO

DOS

IR

Vibrations