Geometry & MOs

Info

ID:	305791
PubChem CID:	124969250
Reduced:	ON4C16H20 (1)
Stoich.:	AB4C16D20 (1)
Weight, g/mol:	408.179755
ΔH_f, kcal/mol:	17.07
Dipole, Da:	2.55
IP(EA), eV:	-9.06(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2R)-2-[5-[(3-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidine-1-carbonyl]-6-methyl-1H-pyrimidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=CN=C1)CN2CCO[C@H](C2)C3=NC(=NC=C3)C

DOS

IR

Vibrations