Geometry & MOs

Info

ID:	305697
PubChem CID:	124965876
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-66.95
Dipole, Da:	5.24
IP(EA), eV:	-9.38(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-N-[[2-[(3S)-oxan-3-yl]pyrimidin-4-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)N1CCN([C@H](C1)C2=CC=CC=C2OC)C(=O)CN3C=CN=C3

DOS

IR

Vibrations