Geometry & MOs

Info

ID:	285777
PubChem CID:	104130787
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	270.184447
ΔH_f, kcal/mol:	-26.97
Dipole, Da:	1.46
IP(EA), eV:	-8.55(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(3-cyclopropylpyrazol-1-yl)-6-methylpyridin-4-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)N(C)C2CCOC2)CN

DOS

IR

Vibrations