Geometry & MOs

Info

ID:	217696
PubChem CID:	85088233
Reduced:	N2O5C21H30 (1)
Stoich.:	A2B5C21D30 (1)
Weight, g/mol:	390.194343
ΔH_f, kcal/mol:	-204.78
Dipole, Da:	3.51
IP(EA), eV:	-8.8(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 18-methyl-7-oxa-8,18-diazatetracyclo[9.7.0.02,8.012,17]octadeca-1(11),12,14,16-tetraene-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)CC(C=CC(=O)OC)C(=O)NC(CC1=CC=C(C=C1)OC)C(=O)NC

DOS

IR

Vibrations