Geometry & MOs

Info

ID:	395212
PubChem CID:	135024923
Reduced:	NOC24H25 (1)
Stoich.:	ABC24D25 (1)
Weight, g/mol:	413.271865
ΔH_f, kcal/mol:	32.2
Dipole, Da:	5.08
IP(EA), eV:	-8.18(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(R)-[4-(dimethylamino)phenyl]-(4-phenylphenyl)methyl]octanal

Drug info:

PubChemData

Smile

C[C@@H](C=O)[C@H](C1=CC=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C

DOS

IR

Vibrations