Geometry & MOs

Info

ID:	438168
PubChem CID:	135227797
Reduced:	O2N4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	339.061526
ΔH_f, kcal/mol:	66.76
Dipole, Da:	4.59
IP(EA), eV:	-8.84(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butylsulfanyl-1,1-bis(4-chlorophenyl)methanamine

Drug info:

PubChemData

Smile

CC(C)/C(=C(/C1=CC(=C(C=C1)[N+](=O)[O-])NCC2=CC=CC=C2)\N(C)N=C)/C

DOS

IR

Vibrations