Geometry & MOs

Info

ID:	41156
PubChem CID:	8145375
Reduced:	N4O4C23H32 (1)
Stoich.:	A4B4C23D32 (1)
Weight, g/mol:	309.209264
ΔH_f, kcal/mol:	-137.58
Dipole, Da:	4.29
IP(EA), eV:	-8.22(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,4Z,8E,12S)-N-(3-methylphenyl)bicyclo[10.1.0]trideca-4,8-diene-13-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N2CCN(CC2)CN3C(=O)C(=O)N(C3=O)[C@H]4CCCC[C@@H]4C

DOS

IR

Vibrations