Geometry & MOs

Info

ID:	145498
PubChem CID:	53535920
Reduced:	SF2N3O4H23C25 (1)
Stoich.:	AB2C3D4E23F25 (1)
Weight, g/mol:	424.180978
ΔH_f, kcal/mol:	-189.69
Dipole, Da:	2.57
IP(EA), eV:	-9.01(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(difluoromethoxy)benzoyl]piperidin-3-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone

Drug info:

PubChemData

Smile

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)COC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations