Geometry & MOs

Info

ID:	367306
PubChem CID:	127324085
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-74.0
Dipole, Da:	3.54
IP(EA), eV:	-8.77(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-1-cyclopropyl-1-methylurea

Drug info:

PubChemData

Smile

C1CCN2CCC(C2C1)NC(=O)N3CCNC(=O)CC3C4=CC=CC=C4

DOS

IR

Vibrations