Geometry & MOs

Info

ID:	81955
PubChem CID:	49855399
Reduced:	N2O3C19H24 (1)
Stoich.:	A2B3C19D24 (1)
Weight, g/mol:	358.189257
ΔH_f, kcal/mol:	-89.92
Dipole, Da:	2.76
IP(EA), eV:	-8.62(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[4-[4-(6-propan-2-yloxypyridin-3-yl)oxyphenyl]butan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)OC1=NC=C(C=C1)OC2=CC=C(C=C2)CCC(C)NC=O

DOS

IR

Vibrations