Geometry & MOs

Info

ID:	145810
PubChem CID:	53597432
Reduced:	N3O4C18H19 (1)
Stoich.:	A3B4C18D19 (1)
Weight, g/mol:	339.150429
ΔH_f, kcal/mol:	-68.78
Dipole, Da:	4.22
IP(EA), eV:	-9.43(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(methylsulfonylmethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C(C1)(CNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])O

DOS

IR

Vibrations