Geometry & MOs

Info

ID:	284629
PubChem CID:	104056366
Reduced:	ClSO3N4C12H19 (1)
Stoich.:	ABC3D4E12F19 (1)
Weight, g/mol:	306.055339
ΔH_f, kcal/mol:	-107.95
Dipole, Da:	6.62
IP(EA), eV:	-9.43(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(aminomethyl)-2-chlorophenyl]sulfonylamino]ethylurea

Drug info:

PubChemData

Smile

CN(C)C(=O)NCCNS(=O)(=O)C1=CC(=C(C=C1)CN)Cl

DOS

IR

Vibrations