Geometry & MOs

Info

ID:	375062
PubChem CID:	131465408
Reduced:	N5C11H17 (1)
Stoich.:	A5B11C17 (1)
Weight, g/mol:	219.148396
ΔH_f, kcal/mol:	69.71
Dipole, Da:	1.83
IP(EA), eV:	-8.98(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2-methyl-1-[1-(2-methylpyrazol-3-yl)pyrazol-3-yl]propan-1-amine

Drug info:

PubChemData

Smile

CCC(C1=NN(C=C1)C2=CC(=NN2C)C)N

DOS

IR

Vibrations