Geometry & MOs

Info

ID:	184287
PubChem CID:	77140139
Reduced:	N2O5C27H32 (1)
Stoich.:	A2B5C27D32 (1)
Weight, g/mol:	377.220223
ΔH_f, kcal/mol:	-144.42
Dipole, Da:	4.65
IP(EA), eV:	-9.03(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[6-hydroxy-2-methyl-5-(6-methylhept-5-en-2-yl)-3,4-dioxocyclohexa-1,5-dien-1-yl]amino]-3-methylbutanoate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=O)C1=O)C(C)CCC=C(C)C)O)N2C=C(C3=CC=CC=C32)CC(C(=O)OC)N

DOS

IR

Vibrations