Geometry & MOs

Info

ID:	244339
PubChem CID:	99344159
Reduced:	SN2O5C26H28 (1)
Stoich.:	AB2C5D26E28 (1)
Weight, g/mol:	386.13972
ΔH_f, kcal/mol:	-115.03
Dipole, Da:	7.43
IP(EA), eV:	-8.42(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(2S)-1-[[1-(2-methoxyphenyl)cyclopropyl]methylamino]-1-oxopropan-2-yl]benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3(CC3)C4=CC=CC=C4OC

DOS

IR

Vibrations