Geometry & MOs

Info

ID:	145998
PubChem CID:	53622883
Reduced:	OSN5C17H25 (1)
Stoich.:	ABC5D17E25 (1)
Weight, g/mol:	321.205242
ΔH_f, kcal/mol:	9.6
Dipole, Da:	6.58
IP(EA), eV:	-8.86(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[cyclopropyl(methyl)amino]ethyl]-3-(3,4-diethoxyphenyl)urea

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NCCCNC3CCCCC3

DOS

IR

Vibrations