Geometry & MOs

Info

ID:	337172
PubChem CID:	127256737
Reduced:	O3C24H38 (1)
Stoich.:	A3B24C38 (1)
Weight, g/mol:	368.344301
ΔH_f, kcal/mol:	-180.31
Dipole, Da:	3.96
IP(EA), eV:	-9.11(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,23Z)-heptacosa-3,23-dien-1,25-diyne

Drug info:

PubChemData

Smile

C[C@]12CCC3=C(C1(CC[C@@H]2C(=O)CO)C)CCC4[C@@]3(CCC(C4(C)C)O)C

DOS

IR

Vibrations