Geometry & MOs

Info

ID:	151774
PubChem CID:	56310575
Reduced:	SN2O4C21H28 (1)
Stoich.:	AB2C4D21E28 (1)
Weight, g/mol:	420.208279
ΔH_f, kcal/mol:	-129.22
Dipole, Da:	6.08
IP(EA), eV:	-7.72(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)-N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1S(=O)(=O)NCC2CCN(C2)C3=CC=CC=C3OC)C)OC

DOS

IR

Vibrations