Geometry & MOs

Info

ID:	129771
PubChem CID:	51073794
Reduced:	ON4C18H20 (1)
Stoich.:	AB4C18D20 (1)
Weight, g/mol:	316.189926
ΔH_f, kcal/mol:	20.54
Dipole, Da:	1.35
IP(EA), eV:	-8.95(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methoxypropyl)-2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]acetamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1CNC(=O)NCC3=CC=CC=C3

DOS

IR

Vibrations