Geometry & MOs

Info

ID:	413156
PubChem CID:	135086101
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	289.146664
ΔH_f, kcal/mol:	-80.11
Dipole, Da:	4.31
IP(EA), eV:	-8.59(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[(E)-2-phenylethenyl]indol-1-yl]butanal

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/C1=CN(C2=CC=CC=C21)CCCC=O

DOS

IR

Vibrations