Geometry & MOs

Info

ID:	286249
PubChem CID:	104169953
Reduced:	ON3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	211.168462
ΔH_f, kcal/mol:	-16.63
Dipole, Da:	3.12
IP(EA), eV:	-9.29(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(2-methoxypropyl)pyrazol-3-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNCC1=CC=NN1CC(C)OC

DOS

IR

Vibrations