Geometry & MOs

Info

ID:	358719
PubChem CID:	127296533
Reduced:	N2O3C20H30 (1)
Stoich.:	A2B3C20D30 (1)
Weight, g/mol:	279.20591
ΔH_f, kcal/mol:	-130.27
Dipole, Da:	2.91
IP(EA), eV:	-8.91(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-cyclopropyltetrazol-5-yl)methyl]-4-propoxyazepane

Drug info:

PubChemData

Smile

CCCOC1CCCN(CC1)CC(=O)NC2CCOC3=CC=CC=C23

DOS

IR

Vibrations