Geometry & MOs

Info

ID:	35934
PubChem CID:	7980517
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	377.126323
ΔH_f, kcal/mol:	-104.3
Dipole, Da:	4.3
IP(EA), eV:	-8.91(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCC(=O)NC2=C(C=C(C=C2)F)C

DOS

IR

Vibrations