Geometry & MOs

Info

ID:	140793
PubChem CID:	52761154
Reduced:	N2O5C25H34 (1)
Stoich.:	A2B5C25D34 (1)
Weight, g/mol:	437.198442
ΔH_f, kcal/mol:	-202.44
Dipole, Da:	3.87
IP(EA), eV:	-8.92(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[(3S)-1-(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)piperidin-3-yl]methyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)N3CCC[C@@H](C3)CNC(=O)OC(C)(C)C)C

DOS

IR

Vibrations