Geometry & MOs

Info

ID:	138551
PubChem CID:	52384194
Reduced:	N2O3C20H30 (1)
Stoich.:	A2B3C20D30 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	-149.04
Dipole, Da:	2.38
IP(EA), eV:	-9.67(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethoxy-3-methylphenyl)-N-methyl-N-[(1R)-1-pyrimidin-4-ylethyl]butanamide

Drug info:

PubChemData

Smile

C1CCCC(CCC1)NC(=O)CCC(=O)NC[C@H](C2=CC=CC=C2)O

DOS

IR

Vibrations