Geometry & MOs

Info

ID:	128534
PubChem CID:	51049076
Reduced:	FN2O2H17C20 (1)
Stoich.:	AB2C2D17E20 (1)
Weight, g/mol:	299.17461
ΔH_f, kcal/mol:	-24.11
Dipole, Da:	4.75
IP(EA), eV:	-9.04(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-phenyl-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C2=NN(C(=O)C=C2)C/C=C/C3=CC=CC=C3)F

DOS

IR

Vibrations