Geometry & MOs

Info

ID:	180573
PubChem CID:	76654311
Reduced:	F2O2N6C23H30 (1)
Stoich.:	A2B2C6D23E30 (1)
Weight, g/mol:	411.171811
ΔH_f, kcal/mol:	-114.83
Dipole, Da:	4.39
IP(EA), eV:	-9.02(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(1-cyanocyclopropyl)amino]-4,4-difluoro-1-oxopentan-2-yl]-1,3-dioxo-2,8-diazaspiro[4.5]decane-8-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC3(CC2)CN(C3)C(=O)NC(CC(CC4=CN=CC=C4)(F)F)C(=O)NCC#N

DOS

IR

Vibrations