Geometry & MOs

Info

ID:	375063
PubChem CID:	131465410
Reduced:	N5C11H17 (1)
Stoich.:	A5B11C17 (1)
Weight, g/mol:	219.148396
ΔH_f, kcal/mol:	75.33
Dipole, Da:	2.54
IP(EA), eV:	-8.97(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1,5-dimethylpyrazol-3-yl)pyrazol-3-yl]propan-1-amine

Drug info:

PubChemData

Smile

CC(C)[C@@H](C1=NN(C=C1)C2=CC=NN2C)N

DOS

IR

Vibrations