Geometry & MOs

Info

ID:	414621
PubChem CID:	135087580
Reduced:	FO2N4C20H23 (1)
Stoich.:	AB2C4D20E23 (1)
Weight, g/mol:	350.184172
ΔH_f, kcal/mol:	-70.54
Dipole, Da:	2.98
IP(EA), eV:	-8.59(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[[2-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]acetyl]amino]methyl]furan-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)NC(=O)CN(C)CCC2=NC3=C(N2)C=C(C=C3)OC

DOS

IR

Vibrations