Geometry & MOs

Info

ID:	350133
PubChem CID:	127277211
Reduced:	SN2O2C11H22 (1)
Stoich.:	AB2C2D11E22 (1)
Weight, g/mol:	391.192963
ΔH_f, kcal/mol:	-106.25
Dipole, Da:	5.21
IP(EA), eV:	-8.68(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCC1CN2CCCCC2

DOS

IR

Vibrations