Geometry & MOs

Info

ID:	399631
PubChem CID:	135041366
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	326.06701
ΔH_f, kcal/mol:	4.97
Dipole, Da:	2.31
IP(EA), eV:	-8.86(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)[C@@H]1[C@H](ON=C1C2=CC=CC=C2)N3CCCC3

DOS

IR

Vibrations