Geometry & MOs

Info

ID:	448565
PubChem CID:	135291899
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	191.142248
ΔH_f, kcal/mol:	-67.14
Dipole, Da:	7.17
IP(EA), eV:	-9.22(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-propan-2-yl-6,7-dihydro-5H-indazol-4-imine

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(C(=C1C=N)N)C2CCCC2)C(=O)C

DOS

IR

Vibrations