Geometry & MOs

Info

ID:	130121
PubChem CID:	51074976
Reduced:	ON4C15H24 (1)
Stoich.:	AB4C15D24 (1)
Weight, g/mol:	326.174276
ΔH_f, kcal/mol:	-22.72
Dipole, Da:	4.42
IP(EA), eV:	-9.61(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-N-methyl-3-[5-(2-methylcyclopropyl)furan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CN(CC1=NN=C2N1CCC2)C(=O)CCC3CCCC3

DOS

IR

Vibrations