Geometry & MOs

Info

ID:	413154
PubChem CID:	135086099
Reduced:	OC16H28 (1)
Stoich.:	AB16C28 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-69.62
Dipole, Da:	2.96
IP(EA), eV:	-9.26(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z)-1-indol-3-ylidene-N-[(2-methyl-1,3-dioxolan-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCC(C=C=C1C(CC[C@H]([C@]1(C)CC)C)C)O

DOS

IR

Vibrations