Geometry & MOs

Info

ID:	236506
PubChem CID:	92713591
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	342.121572
ΔH_f, kcal/mol:	-92.46
Dipole, Da:	3.98
IP(EA), eV:	-8.3(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzodioxol-5-yl)-3-[(3R)-6-methoxy-3,4-dihydro-2H-chromen-3-yl]urea

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)N[C@H]2CC3=C(C=CC(=C3)OC)OC2

DOS

IR

Vibrations