Geometry & MOs

Info

ID:	344346
PubChem CID:	127267522
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	314.09906
ΔH_f, kcal/mol:	-61.25
Dipole, Da:	4.42
IP(EA), eV:	-9.5(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[[6-(2,2,2-trifluoroethoxy)pyridazin-3-yl]methyl]pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)COC(C)C(=O)NC(CC1=CC=CC=C1)C2=NOC=N2

DOS

IR

Vibrations