Geometry & MOs

Info

ID:	173989
PubChem CID:	75709165
Reduced:	N2O3C27H44 (1)
Stoich.:	A2B3C27D44 (1)
Weight, g/mol:	456.254356
ΔH_f, kcal/mol:	-170.51
Dipole, Da:	4.36
IP(EA), eV:	-9.18(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(tert-butylamino)-1-(2,4-dimethylphenyl)-2-oxoethyl]-3-chloro-N-hexylbenzamide

Drug info:

PubChemData

Smile

CCCCCCN(C(CCCCC)C(=O)NC1CCCCC1)C(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations