Geometry & MOs

Info

ID:	212675
PubChem CID:	81061463
Reduced:	O2N3C14H31 (1)
Stoich.:	A2B3C14D31 (1)
Weight, g/mol:	279.194677
ΔH_f, kcal/mol:	-119.78
Dipole, Da:	4.42
IP(EA), eV:	-8.75(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(1-aminoethyl)phenyl]-1-methyl-1-(2-propan-2-yloxyethyl)urea

Drug info:

PubChemData

Smile

CCNC(C)(CCCCN(C)CCOCC)C(=O)N

DOS

IR

Vibrations