Geometry & MOs

Info

ID:	360555
PubChem CID:	127301200
Reduced:	O2N5C20H37 (1)
Stoich.:	A2B5C20D37 (1)
Weight, g/mol:	319.248444
ΔH_f, kcal/mol:	-115.86
Dipole, Da:	4.15
IP(EA), eV:	-8.4(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-cyclopropyltetrazol-5-yl)methyl]-4-[(1-methylpiperidin-2-yl)methyl]piperazine

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC(C1)C(=O)N)N2CCN(CC2)CC3CCCCN3C

DOS

IR

Vibrations