Geometry & MOs

Info

ID:	232575
PubChem CID:	87576450
Reduced:	SN3O4C7H9 (1)
Stoich.:	AB3C4D7E9 (1)
Weight, g/mol:	317.118257
ΔH_f, kcal/mol:	-152.36
Dipole, Da:	3.47
IP(EA), eV:	-9.9(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(3-chloro-4-methylphenyl)-2-(4-propan-2-yloxyphenyl)acetaldehyde

Drug info:

PubChemData

Smile

C1=C(C(=O)NC(=O)N1S)CNCC(=O)O

DOS

IR

Vibrations