Geometry & MOs

Info

ID:	32242
PubChem CID:	6436116
Reduced:	C23H28 (1)
Stoich.:	A23B28 (1)
Weight, g/mol:	416.150285
ΔH_f, kcal/mol:	10.39
Dipole, Da:	1.48
IP(EA), eV:	-8.81(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-but-2-enedioic acid;(3E)-3-(9-chloro-5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)-N,N-dimethylpropan-1-amine

Drug info:

PubChemData

Smile

C/C(=C\C1=CC=CC=C1)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

DOS

IR

Vibrations