Geometry & MOs

Info

ID:	185224
PubChem CID:	77272101
Reduced:	O2N8C25H30 (1)
Stoich.:	A2B8C25D30 (1)
Weight, g/mol:	479.096263
ΔH_f, kcal/mol:	94.71
Dipole, Da:	5.66
IP(EA), eV:	-8.2(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-[4-[(3,5-difluorophenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carbonyl]amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC2=CN=C(N=C2N1C3CCC3)NC4=NC=C(C=C4)N5CC6CCC7(N6)CC5O7

DOS

IR

Vibrations