Geometry & MOs

Info

ID:	42990
PubChem CID:	10317597
Reduced:	ON3C24H33 (1)
Stoich.:	AB3C24D33 (1)
Weight, g/mol:	379.133907
ΔH_f, kcal/mol:	-15.99
Dipole, Da:	5.11
IP(EA), eV:	-8.14(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-chlorophenyl)-6,6-dimethyl-1-phenyl-5,7-dihydropyrrolizin-3-yl]acetic acid

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)CC/C(=N/NC1=CC=C(C=C1)C)/C2=CC=C(C=C2)C

DOS

IR

Vibrations