Geometry & MOs

Info

ID:	284569
PubChem CID:	104053149
Reduced:	NOS2C16H25 (1)
Stoich.:	ABC2D16E25 (1)
Weight, g/mol:	297.122107
ΔH_f, kcal/mol:	-39.73
Dipole, Da:	2.8
IP(EA), eV:	-8.29(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dithian-2-yl)-1-(4-methoxy-2,5-dimethylphenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CCNC(C1CSCCS1)C2=C(C=C(C(=C2)C)OC)C

DOS

IR

Vibrations