Geometry & MOs

Info

ID:	363771
PubChem CID:	127313411
Reduced:	ON3C10H14 (2)
Stoich.:	AB3C10D14 (2)
Weight, g/mol:	398.231791
ΔH_f, kcal/mol:	-19.81
Dipole, Da:	3.52
IP(EA), eV:	-8.93(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2,3-dihydroindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=C(C=N2)C(=O)NCCN3CCN(CC3)C(=O)C4CCC4)C

DOS

IR

Vibrations