Geometry & MOs

Info

ID:	196282
PubChem CID:	78804389
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	331.225977
ΔH_f, kcal/mol:	2.5
Dipole, Da:	2.46
IP(EA), eV:	-8.83(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,5-dimethylpyrazol-1-yl)-N-[(3-methoxy-4-propoxyphenyl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=NN1CCCNCC2=CC(=CC=C2)OC)C

DOS

IR

Vibrations