Geometry & MOs

Info

ID:	256676
PubChem CID:	103140619
Reduced:	N3C13H15 (1)
Stoich.:	A3B13C15 (1)
Weight, g/mol:	223.168462
ΔH_f, kcal/mol:	79.17
Dipole, Da:	4.22
IP(EA), eV:	-9.37(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[3-methyl-1-[(5-methyloxolan-2-yl)methyl]pyrazol-4-yl]methanamine

Drug info:

PubChemData

Smile

C=CCC(C1=CC=CC2=C1C=NC=C2)NN

DOS

IR

Vibrations