Geometry & MOs

Info

ID:	236510
PubChem CID:	92713641
Reduced:	ClN2O4C19H21 (1)
Stoich.:	AB2C4D19E21 (1)
Weight, g/mol:	362.103335
ΔH_f, kcal/mol:	-135.37
Dipole, Da:	4.69
IP(EA), eV:	-8.33(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1Cl)OC)NC(=O)N[C@H]2CC3=C(C=CC(=C3)OC)OC2

DOS

IR

Vibrations