Geometry & MOs

Info

ID:	70263
PubChem CID:	48409813
Reduced:	O3N4C20H26 (1)
Stoich.:	A3B4C20D26 (1)
Weight, g/mol:	373.21139
ΔH_f, kcal/mol:	-78.33
Dipole, Da:	5.06
IP(EA), eV:	-8.83(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-yl]methyl]-2-(phenylcarbamoylamino)propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CCOC)C)CNC(=O)/C=C/C2=CC=C(C=C2)NC(=O)C

DOS

IR

Vibrations