Geometry & MOs

Info

ID:	49979
PubChem CID:	11538573
Reduced:	FOSN3C22H26 (1)
Stoich.:	ABCD3E22F26 (1)
Weight, g/mol:	399.231063
ΔH_f, kcal/mol:	-26.52
Dipole, Da:	5.22
IP(EA), eV:	-8.55(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3,3-diphenyl-N-[(3R)-1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]propanamide

Drug info:

PubChemData

Smile

CSC1=NC2=C(N1C3=CC=C(C=C3)OCCCN4CCCCC4)C=CC(=C2)F

DOS

IR

Vibrations