Geometry & MOs

Info

ID:	206512
PubChem CID:	80263089
Reduced:	N5C16H19 (1)
Stoich.:	A5B16C19 (1)
Weight, g/mol:	337.055085
ΔH_f, kcal/mol:	67.35
Dipole, Da:	4.03
IP(EA), eV:	-8.25(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-5-[(3-methoxy-2-methylpropyl)carbamoyl]-2-methylbenzenesulfonyl chloride

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CN(C)CC2=NC3=C(N2)C=C(C=C3)N

DOS

IR

Vibrations