Geometry & MOs

Info

ID:	436852
PubChem CID:	135212279
Reduced:	NH9C14 (2)
Stoich.:	AB9C14 (2)
Weight, g/mol:	425.217538
ΔH_f, kcal/mol:	142.58
Dipole, Da:	2.48
IP(EA), eV:	-7.93(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methyl-5-oxo-2H-furan-3-yl)-N-[2-[4-[[6-(tetrazol-1-yl)pyridin-3-yl]methylamino]cyclohexyl]ethyl]formamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C3C4=CC=CC=C4C5=CC=CC=C5N3C6=C2C7=CC=CC=C7N6

DOS

IR

Vibrations