Geometry & MOs

Info

ID:	415859
PubChem CID:	135088861
Reduced:	ClOF2N5H10C14 (1)
Stoich.:	ABC2D5E10F14 (1)
Weight, g/mol:	382.164105
ΔH_f, kcal/mol:	-10.14
Dipole, Da:	6.39
IP(EA), eV:	-9.08(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(C(=N1)NCC2=NOC(=N2)C3=C(C=CC=C3F)F)Cl

DOS

IR

Vibrations