Geometry & MOs

Info

ID:	394297
PubChem CID:	135022718
Reduced:	SN2O4H10C14 (1)
Stoich.:	AB2C4D10E14 (1)
Weight, g/mol:	317.177964
ΔH_f, kcal/mol:	-39.52
Dipole, Da:	4.98
IP(EA), eV:	-9.56(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzhydryl-5-methoxy-N,N-dimethylaniline

Drug info:

PubChemData

Smile

COC(=O)/C=C(\C(=C(C#N)C#N)C1=CC=CS1)/C(=O)OC

DOS

IR

Vibrations