Geometry & MOs

Info

ID:	24501
PubChem CID:	610612
Reduced:	O3N6H10C14 (1)
Stoich.:	A3B6C10D14 (1)
Weight, g/mol:	310.081438
ΔH_f, kcal/mol:	114.79
Dipole, Da:	2.43
IP(EA), eV:	-8.95(-2.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(13-oxa-10,12,14,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2,4,6,8,10,14-heptaen-8-ylimino)carbamate

Drug info:

PubChemData

Smile

CCOC(=O)N=NC1=C2C(=NC3=NONC3=N2)C4=CC=CC=C41

DOS

IR

Vibrations