Geometry & MOs

Info

ID:	199926
PubChem CID:	79318051
Reduced:	NOC7H12 (2)
Stoich.:	ABC7D12 (2)
Weight, g/mol:	212.127326
ΔH_f, kcal/mol:	-118.5
Dipole, Da:	4.84
IP(EA), eV:	-8.73(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(3-methylbutyl)tetrazole-5-carboxylate

Drug info:

PubChemData

Smile

CCCC1C(=O)NC(=O)CC12CCCN(CC2)C

DOS

IR

Vibrations