Geometry & MOs

Info

ID:	353259
PubChem CID:	127284439
Reduced:	O2N7C17H29 (1)
Stoich.:	A2B7C17D29 (1)
Weight, g/mol:	340.164774
ΔH_f, kcal/mol:	-22.49
Dipole, Da:	4.46
IP(EA), eV:	-8.9(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2,3-dihydro-1H-indene-1-carbonyl)piperazin-1-yl]-2-(tetrazol-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCN(CC1)C(=O)CN2C=NN=N2)N3CCCCC3

DOS

IR

Vibrations