Geometry & MOs

Info

ID:	187480
PubChem CID:	77578201
Reduced:	PO10C44H81 (1)
Stoich.:	AB10C44D81 (1)
Weight, g/mol:	403.192963
ΔH_f, kcal/mol:	-553.61
Dipole, Da:	2.87
IP(EA), eV:	-9.15(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(1-cyclopentylpropan-2-ylamino)methyl]phenyl]-6-methoxypyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CCCCCCCC(CCOC1C(C(OC(C1OCCCCCCCCCCC=CCCCCCC)OC=CC)CO)OP(=O)(OCC=C)OCC=C)OC

DOS

IR

Vibrations