Geometry & MOs

Info

ID:	348128
PubChem CID:	127273190
Reduced:	N2O3C20H30 (1)
Stoich.:	A2B3C20D30 (1)
Weight, g/mol:	317.210327
ΔH_f, kcal/mol:	-135.17
Dipole, Da:	5.55
IP(EA), eV:	-8.62(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-3-[3-(1-methoxyethyl)phenyl]urea

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)NC(=O)N2CCC(CC2)OC3CCCC3)OC

DOS

IR

Vibrations