Geometry & MOs

Info

ID:	342758
PubChem CID:	127265921
Reduced:	NSF2O4C15H19 (1)
Stoich.:	ABC2D4E15F19 (1)
Weight, g/mol:	312.135304
ΔH_f, kcal/mol:	-263.34
Dipole, Da:	4.32
IP(EA), eV:	-10.13(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(4-chloro-1H-pyrrole-2-carbonyl)piperidin-4-yl]-1-ethyl-1-methylurea

Drug info:

PubChemData

Smile

COC(=O)CC1(CCCC1)NS(=O)(=O)C2=CC=C(C=C2)C(F)F

DOS

IR

Vibrations