Geometry & MOs

Info

ID:	31697
PubChem CID:	857743
Reduced:	N6C17H26 (1)
Stoich.:	A6B17C26 (1)
Weight, g/mol:	300.169859
ΔH_f, kcal/mol:	87.75
Dipole, Da:	7.44
IP(EA), eV:	-8.64(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-benzyltetrazol-5-yl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)[C@@H](C2=CC=CC=C2)C3=NN=NN3C(C)C

DOS

IR

Vibrations