Geometry & MOs

Info

ID:	255397
PubChem CID:	103131763
Reduced:	N3C14H25 (1)
Stoich.:	A3B14C25 (1)
Weight, g/mol:	224.116092
ΔH_f, kcal/mol:	8.94
Dipole, Da:	3.61
IP(EA), eV:	-8.49(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-(1-methylpyrazol-3-yl)-4-oxopentanoate

Drug info:

PubChemData

Smile

CCCNC1CCCCCC1C2=NN(C=C2)C

DOS

IR

Vibrations