Geometry & MOs

Info

ID:	286258
PubChem CID:	104169962
Reduced:	ON3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	211.168462
ΔH_f, kcal/mol:	-19.71
Dipole, Da:	1.02
IP(EA), eV:	-8.79(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCNCC1=NN(C=C1)CC(C)OC

DOS

IR

Vibrations