Geometry & MOs

Info

ID:	193579
PubChem CID:	78408543
Reduced:	O3N5C13H19 (1)
Stoich.:	A3B5C13D19 (1)
Weight, g/mol:	293.148789
ΔH_f, kcal/mol:	-55.93
Dipole, Da:	6.8
IP(EA), eV:	-8.48(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(6-carbamoylpyridazin-3-yl)hydrazinylidene]butanoate

Drug info:

PubChemData

Smile

CC(=NNC1=NN=C(C=C1)N2CCOCC2)CCC(=O)O

DOS

IR

Vibrations