Geometry & MOs

Info

ID:	150057
PubChem CID:	53789742
Reduced:	SN5O6C35H45 (1)
Stoich.:	AB5C6D35E45 (1)
Weight, g/mol:	411.19582
ΔH_f, kcal/mol:	-209.57
Dipole, Da:	6.64
IP(EA), eV:	-9.3(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl N-(2,3-dihydro-1H-indol-7-yl)carbamate

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N=C(C1=CC=C(C=C1)C[C@@H](C(=O)N2CCC[C@H]2C(=O)O)NC(C)(C)C)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations