Geometry & MOs

Info

ID:	171341
PubChem CID:	75364006
Reduced:	O2N3C22H35 (1)
Stoich.:	A2B3C22D35 (1)
Weight, g/mol:	231.11201
ΔH_f, kcal/mol:	-116.47
Dipole, Da:	7.83
IP(EA), eV:	-9.12(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-ethoxy-1-[4-(tetrazol-1-yl)phenyl]ethanimine

Drug info:

PubChemData

Smile

CC(C)(C)CC(=O)N1CCC(=NNC(=O)C23CC4CC(C2)CC(C4)C3)CC1

DOS

IR

Vibrations