Geometry & MOs

Info

ID:	31260
PubChem CID:	855376
Reduced:	N6C19H30 (1)
Stoich.:	A6B19C30 (1)
Weight, g/mol:	330.180424
ΔH_f, kcal/mol:	70.0
Dipole, Da:	6.24
IP(EA), eV:	-8.29(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C[C@H](C1=NN=NN1C(C)C)N2CCN(CC2)C3=CC=CC=C3

DOS

IR

Vibrations