Geometry & MOs

Info

ID:	357189
PubChem CID:	127293693
Reduced:	SN2O3C20H22 (1)
Stoich.:	AB2C3D20E22 (1)
Weight, g/mol:	294.140199
ΔH_f, kcal/mol:	-80.08
Dipole, Da:	9.67
IP(EA), eV:	-8.99(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperidin-1-ylsulfonyl-1,3,4,5-tetrahydro-2-benzazepine

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CN(C1)S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

DOS

IR

Vibrations