Geometry & MOs

Info

ID:	277541
PubChem CID:	103829294
Reduced:	ClNOH4C6 (2)
Stoich.:	ABCD4E6 (2)
Weight, g/mol:	288.187149
ΔH_f, kcal/mol:	-39.58
Dipole, Da:	5.93
IP(EA), eV:	-8.71(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[(1R,4S)-1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl]amino]propyl]methanesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=NC=CC(=C2)Cl)Cl)O

DOS

IR

Vibrations