Geometry & MOs

Info

ID:	121188
PubChem CID:	50758033
Reduced:	N3O3C20H29 (1)
Stoich.:	A3B3C20D29 (1)
Weight, g/mol:	334.168128
ΔH_f, kcal/mol:	-127.26
Dipole, Da:	4.23
IP(EA), eV:	-8.6(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-4,5-dihydro-3H-1-benzazepin-2-one

Drug info:

PubChemData

Smile

CC(C(=O)NCCCN1CCOCC1)N2C(=O)CCCC3=CC=CC=C32

DOS

IR

Vibrations