Geometry & MOs

Info

ID:	352051
PubChem CID:	127283119
Reduced:	NO2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	364.199822
ΔH_f, kcal/mol:	-190.11
Dipole, Da:	5.59
IP(EA), eV:	-8.29(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-3-[(4-hydroxyoxan-4-yl)methyl]urea

Drug info:

PubChemData

Smile

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)NCC3(CCCCC3)O

DOS

IR

Vibrations