Geometry & MOs

Info

ID:	323313
PubChem CID:	126674118
Reduced:	ClO2N7C18H24 (1)
Stoich.:	AB2C7D18E24 (1)
Weight, g/mol:	336.183778
ΔH_f, kcal/mol:	-27.25
Dipole, Da:	5.83
IP(EA), eV:	-8.38(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)piperidin-3-yl]carbamic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1CC2CC(CC2N1)NC3=NC(=NC=C3Cl)NC4=CN(N=C4)C

DOS

IR

Vibrations