Geometry & MOs

Info

ID:	253309
PubChem CID:	103117627
Reduced:	N4C9H18 (1)
Stoich.:	A4B9C18 (1)
Weight, g/mol:	246.184447
ΔH_f, kcal/mol:	35.83
Dipole, Da:	3.97
IP(EA), eV:	-8.54(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-ethyl-2-N-[(1-methylindazol-3-yl)methyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(CNC)NCC1=NN(C=C1)C

DOS

IR

Vibrations