Geometry & MOs

Info

ID:	244392
PubChem CID:	99350591
Reduced:	N3O3C25H29 (1)
Stoich.:	A3B3C25D29 (1)
Weight, g/mol:	406.189257
ΔH_f, kcal/mol:	-68.19
Dipole, Da:	5.71
IP(EA), eV:	-7.78(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3S)-1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-(phenoxymethyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CC[C@@H](C2)CNC(=O)/C=C/C3=CC=C(C=C3)N4CCCC4=O

DOS

IR

Vibrations