Geometry & MOs

Info

ID:	347112
PubChem CID:	127271616
Reduced:	FN4O4C19H27 (1)
Stoich.:	AB4C4D19E27 (1)
Weight, g/mol:	351.19582
ΔH_f, kcal/mol:	-207.12
Dipole, Da:	5.48
IP(EA), eV:	-9.02(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-(2-methylpropyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)CN1CCN(CC1)C(=O)NCC2=CC(=CC3=C2OCOC3)F

DOS

IR

Vibrations