Geometry & MOs

Info

ID:	349315
PubChem CID:	127275102
Reduced:	FNO2C8H10 (2)
Stoich.:	ABC2D8E10 (2)
Weight, g/mol:	374.220557
ΔH_f, kcal/mol:	-253.73
Dipole, Da:	6.19
IP(EA), eV:	-9.05(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-1,4-oxazepan-4-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylpropanamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(C)C(=O)NC2=CC3=C(C=C2)OC(O3)(F)F

DOS

IR

Vibrations