Geometry & MOs

Info

ID:	43196
PubChem CID:	10319427
Reduced:	N3O5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	411.277344
ΔH_f, kcal/mol:	-169.44
Dipole, Da:	6.99
IP(EA), eV:	-8.48(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[4-(2-hydroxy-3,3-dimethylbutoxy)-3-methylphenyl]pentan-3-yl]-2-methylbenzamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CC1C(=O)NC(=O)N1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations