Geometry & MOs

Info

ID:	445973
PubChem CID:	135270250
Reduced:	ON2C33H58 (1)
Stoich.:	AB2C33D58 (1)
Weight, g/mol:	452.17723
ΔH_f, kcal/mol:	-116.33
Dipole, Da:	0.67
IP(EA), eV:	-8.14(1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-amino-1-methyl-5-(5-phenyl-1,3,4-oxadiazol-2-yl)-2H-pyrazin-3-yl]-3-(difluoromethyl)-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)CCC(=C)NC2CC3(CC(C2)(N(C3)C(=C)OCC4CCC(CC4)C)C)C

DOS

IR

Vibrations