Geometry & MOs

Info

ID:	216646
PubChem CID:	85086556
Reduced:	O2N4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	288.169859
ΔH_f, kcal/mol:	-76.93
Dipole, Da:	5.1
IP(EA), eV:	-9.29(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-oxo-2H-indazol-3-ylidene)methylamino]-2-pentylguanidine

Drug info:

PubChemData

Smile

CCCN1C(CC(=O)N(C1=O)CCC)NC2=CC=CC=N2

DOS

IR

Vibrations