Geometry & MOs

Info

ID:	236499
PubChem CID:	92713508
Reduced:	FN2O2H15C16 (1)
Stoich.:	AB2C2D15E16 (1)
Weight, g/mol:	312.147393
ΔH_f, kcal/mol:	-87.17
Dipole, Da:	3.25
IP(EA), eV:	-8.96(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-3,4-dihydro-2H-chromen-3-yl]-3-(4-ethoxyphenyl)urea

Drug info:

PubChemData

Smile

C1[C@H](COC2=CC=CC=C21)NC(=O)NC3=CC=C(C=C3)F

DOS

IR

Vibrations