Geometry & MOs

Info

ID:	138841
PubChem CID:	52433400
Reduced:	N3O6C22H25 (1)
Stoich.:	A3B6C22D25 (1)
Weight, g/mol:	450.145868
ΔH_f, kcal/mol:	-168.17
Dipole, Da:	2.19
IP(EA), eV:	-8.63(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-chlorophenyl)-N-[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]-2-methoxyacetamide

Drug info:

PubChemData

Smile

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C(=O)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations