Geometry & MOs

Info

ID:	217783
PubChem CID:	85088381
Reduced:	OC28H46 (1)
Stoich.:	AB28C46 (1)
Weight, g/mol:	398.02258
ΔH_f, kcal/mol:	-108.6
Dipole, Da:	4.04
IP(EA), eV:	-9.8(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(11-amino-12-bromo-7-methoxy-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl)methyl carbamate

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4=C)C)C

DOS

IR

Vibrations