Geometry & MOs

Info

ID:	305539
PubChem CID:	124958915
Reduced:	O3N5C15H19 (1)
Stoich.:	A3B5C15D19 (1)
Weight, g/mol:	317.148789
ΔH_f, kcal/mol:	-33.19
Dipole, Da:	5.26
IP(EA), eV:	-9.12(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3S)-3-hydroxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methyl]-N-methyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC=N1)N2CC[C@@](C2)(CN(C)C(=O)C3=NOC=C3)O

DOS

IR

Vibrations