Geometry & MOs

Info

ID:	357181
PubChem CID:	127293685
Reduced:	NSO4C15H25 (1)
Stoich.:	ABC4D15E25 (1)
Weight, g/mol:	370.135114
ΔH_f, kcal/mol:	-178.79
Dipole, Da:	6.48
IP(EA), eV:	-9.38(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(1,3,4,5-tetrahydro-2-benzazepin-2-ylsulfonyl)-2,3-dihydroindol-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(=O)C2)CS(=O)(=O)N(C)C3CCOC3)C

DOS

IR

Vibrations