Geometry & MOs

Info

ID:	345369
PubChem CID:	127269669
Reduced:	N2O3C21H30 (1)
Stoich.:	A2B3C21D30 (1)
Weight, g/mol:	357.241627
ΔH_f, kcal/mol:	-136.7
Dipole, Da:	3.05
IP(EA), eV:	-8.02(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(cyclopentylmethyl)piperidin-4-yl]-3-(3,4-dihydro-2H-chromen-6-yl)urea

Drug info:

PubChemData

Smile

C1CCC(CC1)OC2CCN(CC2)C(=O)NC3=CC4=C(C=C3)OCCC4

DOS

IR

Vibrations