Geometry & MOs

Info

ID:	125773
PubChem CID:	50937767
Reduced:	FN3O5C15H16 (1)
Stoich.:	AB3C5D15E16 (1)
Weight, g/mol:	376.182064
ΔH_f, kcal/mol:	-59.2
Dipole, Da:	4.7
IP(EA), eV:	-9.74(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]sulfonyl]phenyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CN1C[C@@]2(CC(=C[C@](C2)(C1)[N+](=O)[O-])OC3=CC=C(C=C3)F)[N+](=O)[O-]

DOS

IR

Vibrations