Geometry & MOs

Info

ID:	150903
PubChem CID:	53790600
Reduced:	O2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	570.283548
ΔH_f, kcal/mol:	-61.06
Dipole, Da:	2.0
IP(EA), eV:	-10.15(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-[4-(diethylamino)-2-methylphenyl]methyl]-N,N-diethyl-3-methylaniline

Drug info:

PubChemData

Smile

CC1=CC(=O)CC(C1=CC=O)(C)C

DOS

IR

Vibrations