Geometry & MOs

Info

ID:	398978
PubChem CID:	135036728
Reduced:	N3O4C9H13 (1)
Stoich.:	A3B4C9D13 (1)
Weight, g/mol:	153.115364
ΔH_f, kcal/mol:	-89.75
Dipole, Da:	2.12
IP(EA), eV:	-10.2(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,8aS)-2-methylidene-3,5,6,7,8,8a-hexahydro-1H-indolizin-1-ol

Drug info:

PubChemData

Smile

CC1(C(C1(C(=O)OC)C(=O)OC)N=[N+]=[N-])C

DOS

IR

Vibrations