Geometry & MOs

Info

ID:	149442
PubChem CID:	53789115
Reduced:	SO5C30H54 (1)
Stoich.:	AB5C30D54 (1)
Weight, g/mol:	367.262363
ΔH_f, kcal/mol:	-325.43
Dipole, Da:	4.66
IP(EA), eV:	-9.36(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethane;N-methylmethanamine;3-methyl-2-(phenylhydrazinylidene)naphthalen-1-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC=C1CC[C@H]([C@@H]([C@H]1SCC(=O)O)O)CCCCCCCC(=O)O

DOS

IR

Vibrations