Geometry & MOs

Info

ID:	272202
PubChem CID:	103735083
Reduced:	ClINO2C12H15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	184.157563
ΔH_f, kcal/mol:	-55.4
Dipole, Da:	4.49
IP(EA), eV:	-9.5(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-ethylcyclopropyl)methyl]-3-propylurea

Drug info:

PubChemData

Smile

CC(COC)N(C)C(=O)C1=CC(=C(C=C1)I)Cl

DOS

IR

Vibrations