Geometry & MOs

Info

ID:	244433
PubChem CID:	99350821
Reduced:	N2O2C23H28 (1)
Stoich.:	A2B2C23D28 (1)
Weight, g/mol:	364.215078
ΔH_f, kcal/mol:	-53.68
Dipole, Da:	3.14
IP(EA), eV:	-7.82(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1H-inden-5-yl)-N-[[(3S)-1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CC[C@@H](C2)CNC(=O)CC3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations