Geometry & MOs

Info

ID:	130884
PubChem CID:	51120750
Reduced:	O2N3C18H27 (1)
Stoich.:	A2B3C18D27 (1)
Weight, g/mol:	349.182398
ΔH_f, kcal/mol:	-87.21
Dipole, Da:	3.65
IP(EA), eV:	-8.12(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1CCCCNC1=O)C2=CC(=CC(=C2)C)C

DOS

IR

Vibrations