Geometry & MOs

Info

ID:	416754
PubChem CID:	135090287
Reduced:	FN4O4C18H23 (1)
Stoich.:	AB4C4D18E23 (1)
Weight, g/mol:	385.200156
ΔH_f, kcal/mol:	-127.63
Dipole, Da:	6.93
IP(EA), eV:	-8.88(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,2R)-2-(hydroxymethyl)cyclopentyl]-5-(4-methoxyphenyl)-3-pyrrolidin-1-yl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=NOC(=C1C(=O)NCCC(=O)N(C)C)C2=CC(=C(C=C2)F)OC

DOS

IR

Vibrations