Geometry & MOs

Info

ID:	256642
PubChem CID:	103140415
Reduced:	NOSC14H21 (1)
Stoich.:	ABCD14E21 (1)
Weight, g/mol:	236.174945
ΔH_f, kcal/mol:	-44.72
Dipole, Da:	3.07
IP(EA), eV:	-8.61(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1,4-diazabicyclo[2.2.2]octan-2-yl-(1-methylpyrazol-3-yl)methyl]hydrazine

Drug info:

PubChemData

Smile

CC1CCC(O1)CSC2=CC=C(C=C2)C(C)N

DOS

IR

Vibrations