Geometry & MOs

Info

ID:	191417
PubChem CID:	78144772
Reduced:	NOC10H14 (2)
Stoich.:	ABC10D14 (2)
Weight, g/mol:	463.107908
ΔH_f, kcal/mol:	-96.65
Dipole, Da:	2.92
IP(EA), eV:	-7.76(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[2-amino-4-(fluoromethyl)-6-(trifluoromethyl)-5,6-dihydro-1,3-oxazin-4-yl]-4-fluorophenyl]-5-(fluoromethoxy)pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC2=C(C=C1)NC(C3C2OCCC3)C4CCCCC4

DOS

IR

Vibrations