Geometry & MOs

Info

ID:	290075
PubChem CID:	104406816
Reduced:	ClN2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	196.168797
ΔH_f, kcal/mol:	2.71
Dipole, Da:	0.76
IP(EA), eV:	-8.44(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,1-N-dimethyl-2-N-[(5-methyl-1H-pyrazol-3-yl)methyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(CN(C)C)NCCC1=CC=CC=C1Cl

DOS

IR

Vibrations