Geometry & MOs

Info

ID:	217502
PubChem CID:	85087911
Reduced:	O2N3C22H31 (1)
Stoich.:	A2B3C22D31 (1)
Weight, g/mol:	369.19715
ΔH_f, kcal/mol:	-77.78
Dipole, Da:	5.22
IP(EA), eV:	-9.13(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-O-tert-butyl 2-O-methyl 3-(1-trimethylsilyloxyethenyl)-7-azabicyclo[2.2.1]heptane-2,7-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)N(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)N)O

DOS

IR

Vibrations