Geometry & MOs

Info

ID:	419323
PubChem CID:	135107977
Reduced:	ClN4C22H25 (1)
Stoich.:	AB4C22D25 (1)
Weight, g/mol:	377.175084
ΔH_f, kcal/mol:	38.99
Dipole, Da:	3.53
IP(EA), eV:	-8.42(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-fluoro-3-methoxyphenyl)-3-[(2-methyl-2-pyrrolidin-1-ylpropyl)amino]-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C=C(C=C2)Cl)CN3CCCC4(C3)CCC5=CN=C(N=C45)C

DOS

IR

Vibrations