Geometry & MOs

Info

ID:	133255
PubChem CID:	51498975
Reduced:	FN2O3C21H23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	379.189592
ΔH_f, kcal/mol:	-143.25
Dipole, Da:	5.3
IP(EA), eV:	-8.27(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-acetyl-2-methyl-2,3-dihydroindol-5-yl]-2-oxo-1,5,6,7,8,9-hexahydrocyclohepta[b]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](C(=O)NC1=CC2=C(C=C1)N([C@@H](C2)C)C(=O)C)OC3=CC=CC=C3F

DOS

IR

Vibrations