Geometry & MOs

Info

ID:	129064
PubChem CID:	51068480
Reduced:	N3O4H27C30 (1)
Stoich.:	A3B4C27D30 (1)
Weight, g/mol:	415.189592
ΔH_f, kcal/mol:	6.57
Dipole, Da:	7.01
IP(EA), eV:	-9.29(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-N-[(3-methyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1CN(CC2=CC=CO2)C(=O)C3=CC=C(C=C3)OC)OC4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations