Geometry & MOs

Info

ID:	345352
PubChem CID:	127269652
Reduced:	N2O4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	383.200905
ΔH_f, kcal/mol:	-152.56
Dipole, Da:	4.9
IP(EA), eV:	-8.23(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)NC(=O)NCC3COCCO3)OC1

DOS

IR

Vibrations