Geometry & MOs

Info

ID:	310957
PubChem CID:	126588604
Reduced:	N2O2C21H28 (1)
Stoich.:	A2B2C21D28 (1)
Weight, g/mol:	312.183778
ΔH_f, kcal/mol:	-72.73
Dipole, Da:	4.13
IP(EA), eV:	-8.35(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(4-ethyl-2-methylphenoxy)methyl]-5-methylphenyl]-3-methylurea

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=C(C=C2)C(C)C)NC(=O)NC)C

DOS

IR

Vibrations