Geometry & MOs

Info

ID:	448820
PubChem CID:	135293808
Reduced:	NC36H47 (1)
Stoich.:	AB36C47 (1)
Weight, g/mol:	450.184084
ΔH_f, kcal/mol:	49.8
Dipole, Da:	1.49
IP(EA), eV:	-8.74(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dichloro-N'-[(3S)-2,2-dimethylhexan-3-yl]-N'-[(S)-(3,5-dimethylphenyl)-hydroxymethyl]benzohydrazide

Drug info:

PubChemData

Smile

CCCCCCCCC/C=C\C(=C(/C1=CC=CC=C1)\C2=CC=C(C=C2)CCCN(C)C)\C3=CC=CC=C3

DOS

IR

Vibrations